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Home > Boronic Acids > 138642-62-3
138642-62-3 | Boronic acid, B-(2-cyanophenyl)-
CAS No: 138642-62-3 Catalog No: AG0018XL MDL No:MFCD01632208
Product Description
Catalog Number:
AG0018XL
Chemical Name:
Boronic acid, B-(2-cyanophenyl)-
CAS Number:
138642-62-3
Molecular Formula:
C7H6BNO2
Molecular Weight:
146.9390
MDL Number:
MFCD01632208
IUPAC Name:
(2-cyanophenyl)boronic acid
InChI:
InChI=1S/C7H6BNO2/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4,10-11H
InChI Key:
NPLZNDDFVCGRAG-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1B(O)O
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.049g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
146.94g/mol
Monoisotopic Mass:
147.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Rhodium-catalyzed annulation reactions of 2-cyanophenylboronic acid with alkynes and strained alkenes. | Organic letters 20050721 |
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